Molecule FYI-1006263

A

Molecule Summary:

ID: FYI-1006263
Names:
InChIKey: UWLXMDBDYJMMAM-UHFFFAOYSA-N
SMILES: Oc5ccc4NC2C(CCN3CC1CC(O)OCC1CC23)c4c5

Received at FYIcenter.com on: 2023-12-06

Molecule ID: FYI-1006263 Edit

Molecule Structure InChIKey: UWLXMDBDYJMMAM-UHFFFAOYSA-N

Molecule Structure SMILES String: Oc5ccc4NC2C(CCN3CC1CC(O)OCC1CC23)c4c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1006263
FYIcenter.com

 23 27  0  0  0  0  0  0  0  0999 V2000
    8.6011   10.8568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3887   10.1568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1764   10.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9638   10.1568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9638    8.7568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9235    7.8201    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4929    6.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8853    6.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7081    5.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1387    4.2759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7464    4.1296    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1770    2.8505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 22  5  1  0  0  0  0
 23 22  2  0  0  0  0
 23  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006263-3D
FYIcenter.com

 47 51  0  0  1  0  0  0  0  0999 V2000
    1.3896   -0.2326    0.7718 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7505    0.0352    0.7540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9687    1.6826    0.5360 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5404    1.9592    0.1748 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8425    0.5036    0.1893 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7973    0.0819   -1.2686 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6088    0.8568   -0.4648 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.5496   -0.1779    0.8571 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.5322    0.8358    1.5885 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8856    2.1893    1.9341 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6497    2.5846    1.1848 N   0  0  3  0  0  0  0  0  0  0  0  0
    5.4126    1.9852    2.1687 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4266    0.5776    1.5974 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.2540   -0.3539    2.7803 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5757   -1.9326    2.0793 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.3883   -2.2964    2.7709 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1276    0.2174   -0.5924 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.2319    1.4690   -1.6971 C   0  0  0  0  0  0  0  0  0  0  0  0
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 22 23  1  0  0  0  0
 23 47  1  0  0  0  0
M  END
$$$$

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2023-12-14, 1565👍, 0💬